1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine

C15H19N7O — CID 166278799

IUPAC1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine
SMILESCn1nccc1[C@@H]1OCC[C@H]1CNc1ncnc2cnn(C)c12
InChIInChI=1S/C15H19N7O/c1-21-12(3-5-19-21)14-10(4-6-23-14)7-16-15-13-11(17-9-18-15)8-20-22(13)2/h3,5,8-10,14H,4,6-7H2,1-2H3,(H,16,17,18)/t10-,14+/m0/s1
InChIKeyCHUUPDOGDWXHPP-IINYFYTJSA-N
MW313.37 g/mol
LogP1.29
Rot. Bonds4

About 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine

1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine (PubChem CID 166278799) has the molecular formula C15H19N7O and a molecular weight of 313.37 g/mol. Its IUPAC name is 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine.

Molecular Properties

Compound Name1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine
PubChem CID166278799
Molecular FormulaC15H19N7O
Molecular Weight313.37 g/mol
Exact Mass313.17
IUPAC Name1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine
SMILESCn1nccc1[C@@H]1OCC[C@H]1CNc1ncnc2cnn(C)c12
InChIInChI=1S/C15H19N7O/c1-21-12(3-5-19-21)14-10(4-6-23-14)7-16-15-13-11(17-9-18-15)8-20-22(13)2/h3,5,8-10,14H,4,6-7H2,1-2H3,(H,16,17,18)/t10-,14+/m0/s1
InChIKeyCHUUPDOGDWXHPP-IINYFYTJSA-N
XLogP1.29
TPSA82.68 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.37
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine?
The IUPAC name of 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine (CID 166278799) is 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine.
What is the SMILES notation for 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine?
The canonical SMILES for 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine is Cn1nccc1[C@@H]1OCC[C@H]1CNc1ncnc2cnn(C)c12.
What is the InChIKey of 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine?
The InChIKey is CHUUPDOGDWXHPP-IINYFYTJSA-N. The full InChI is InChI=1S/C15H19N7O/c1-21-12(3-5-19-21)14-10(4-6-23-14)7-16-15-13-11(17-9-18-15)8-20-22(13)2/h3,5,8-10,14H,4,6-7H2,1-2H3,(H,16,17,18)/t10-,14+/m0/s1.
What are the key properties of 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine?
1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine has a molecular weight of 313.37 g/mol, XLogP of 1.29, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[[(2R,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]methyl]pyrazolo[4,5-d]pyrimidin-7-amine is sourced from PubChem (CID 166278799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).